CID 146388

92928-47-7

Structural Information

Molecular Formula
C22H27N5S
SMILES
CCN(CC)CCN1C2=CC=CC=C2C(=NNC3=NCCS3)C4=CC=CC=C41
InChI
InChI=1S/C22H27N5S/c1-3-26(4-2)14-15-27-19-11-7-5-9-17(19)21(18-10-6-8-12-20(18)27)24-25-22-23-13-16-28-22/h5-12H,3-4,13-16H2,1-2H3,(H,23,25)
InChIKey
OFJBLFHGVVUQEU-UHFFFAOYSA-N
Compound name
N-[[10-[2-(diethylamino)ethyl]acridin-9-ylidene]amino]-4,5-dihydro-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

11
References

3
Patents

393.19873 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 394.20601 192.0
[M+Na]+ 416.18795 205.3
[M+NH4]+ 411.23255 200.9
[M+K]+ 432.16189 195.4
[M-H]- 392.19145 199.1
[M+Na-2H]- 414.17340 200.5
[M]+ 393.19818 196.4
[M]- 393.19928 196.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe